2-azanyl-3-methanoyl-2-[2-(4-methoxyphenyl)ethyl]hexanedioic acid

Systemtic Name: 2-azanyl-3-methanoyl-2-[2-(4-methoxyphenyl)ethyl]hexanedioic acid Openeye Name: 2-amino-3-formyl-2-[2-(4-methoxyphenyl)ethyl]hexanedioic acid CAS Name: 2-amino-3-formyl-2-[2-(4-methoxyphenyl)ethyl]hexanedioic acid IUPAC Name: 2-amino-3-formyl-2-[2-(4-methoxyphenyl)ethyl]hexanedioic acid Traditional Name: 2-amino-3-formyl-2-[2-(4-methoxyphenyl)ethyl]adipic acid Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(C(CCC(=O)O)C=O)(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)CCC(C(CCC(=O)O)C=O)(C(=O)O)N

InChI

InChI=1S/C16H21NO6/c1-23-13-5-2-11(3-6-13)8-9-16(17,15(21)22)12(10-18)4-7-14(19)20/h2-3,5-6,10,12H,4,7-9,17H2,1H3,(H,19,20)(H,21,22)